SCHEMBL11423902

SCHEMBL11423902

N#Cc1ccc2c(c1)c1ccccc1c1cc(-c3ccc(-c4cc5c6ccccc6c6cc(C#N)ccc6c5c5ccccc45)cc3)c3ccccc3c21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
METAP2 P50579 1/20 0.37
TNKS O95271 1/20 0.37
MGAM O43451 1/20 0.36
GAA P10253 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.35
XDH P47989 1/20 0.35
SLC22A12 Q96S37 1/20 0.35
AR P10275 1/20 0.35
FASN P49327 1/20 0.34
GRM2 Q14416 1/20 0.34
G6PD P11413 2/20 0.33
CYP19A1 P11511 1/20 0.33
CCNB2 O95067 1/20 0.33
CDK1 P06493 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL13171073 0.91 TNKS (0.43) CA1CA2MEN1KMT2AMETAP2
SCHEMBL13192377 0.90 MAP4K4 (0.39) CA1CA2METAP2TNKSGRM2
SCHEMBL13171090 0.90 MMP3 (0.42) CA1CA2METAP2TNKSXDH
SCHEMBL14066870 0.88 TNKS (0.43) CA1CA2MEN1KMT2AMETAP2
SCHEMBL13171052 0.88 GABRA1 (0.41) METAP2TNKSPTGDR2XDHSLC22A12
SCHEMBL13192001 0.86 TSHR (0.46) CA1CA2MEN1KMT2AMETAP2
SCHEMBL13192425 0.84 MMP3 (0.47) CA1CA2METAP2TNKSXDH
SCHEMBL13171038 0.84 PTPN5 (0.46) MEN1KMT2AXDHSLC22A12AR
SCHEMBL13171105 0.84 CYP11B1 (0.47) CA1CA2TNKSXDHSLC22A12
SCHEMBL13171041 0.83 TNKS (0.40) CA1CA2MEN1KMT2ATNKS

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2216313-B1 BENZOCHRYSENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME IDEMITSU KOSAN CO (JP) 2013-02-20 EP disclosed
US-8222637-B2 Benzochrysene derivative and organic electroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2012-07-17 US disclosed
US-20100320451-A1 BENZOCHRYSENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. 2010-12-23 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100320451-A1 BENZOCHRYSENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME NRAS, KSR1, RSU1 CA1 1348/4885CA2 1823/4885MEN1 283/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.